Ethyl 4-(Chlorosulfonyl)-2,5-Dimethyl-1-Phenyl-1H-Pyrrole-3-Carboxylate
[CAS# 306936-28-7]

Identification

• Name: Ethyl 4-(Chlorosulfonyl)-2,5-Dimethyl-1-Phenyl-1H-Pyrrole-3-Carboxylate
• Synonyms: 1H-PYRROLE-3-CARBOXYLICACID, 4-(CHLOROSULFONYL)-2,5-DIMETHYL-1-PHENYL-, ETHYL ESTER; Ethyl 3-chlorosulfonyl-2,5-dimethyl-1-phenylpyrrole-4-carboxylate; Ethyl 3-chlorosulphonyl-2,5-dimethyl-1-phenylpyrrole-4-carboxylate 95%
• Molecular Formula: C₁₅H₁₆ClNO₄S
• Molecular Weight: 341.81
• CAS Registry Number: 306936-28-7
• SMILES: ClS(=O)(=O)c2c(c(n(c1ccccc1)c2C)C)C(=O)OCC
• InChI: 1S/C15H16ClNO4S/c1-4-21-15(18)13-10(2)17(12-8-6-5-7-9-12)11(3)14(13)22(16,19)20/h5-9H,4H2,1-3H3
• InChIKey: BVFOSADNTRNLQQ-UHFFFAOYSA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Melting point: 82-85°C (Expl.)
• Boiling point: 486.613°C at 760 mmHg (Cal.)
• Flash point: 248.095°C (Cal.)
• Refractive index: 1.584 (Cal.)

Safety Data

• Safety Description: Irritant